1-[(5-bromanylthiophen-3-yl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-3-yl)carbonylamino]-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[(5-bromothiophene-3-carbonyl)amino]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[[(5-bromo-3-thiophenyl)-oxomethyl]amino]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(5-bromothiophene-3-carbonyl)amino]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[(5-bromothiophene-3-carbonyl)amino]-4-methyl-cyclohexanecarboxylic acid Formula: C13H16BrNO3S MolecularWeight: 346.24004

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CSC(=C2)Br

Isomeric SMILES

CC1CCC(CC1)(C(=O)O)NC(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C13H16BrNO3S/c1-8-2-4-13(5-3-8,12(17)18)15-11(16)9-6-10(14)19-7-9/h6-8H,2-5H2,1H3,(H,15,16)(H,17,18)